ethyl 7-(dimethylamino)-1-[[7-(dimethylamino)-3-ethoxycarbonyl-2-methylsulfanyl-indolizin-1-yl]-phenyl-methyl]-2-methylsulfanyl-indolizine-3-carboxylate

Systemtic Name: ethyl 7-(dimethylamino)-1-[[7-(dimethylamino)-3-ethoxycarbonyl-2-methylsulfanyl-indolizin-1-yl]-phenyl-methyl]-2-methylsulfanyl-indolizine-3-carboxylate Openeye Name: ethyl 7-(dimethylamino)-1-[[7-(dimethylamino)-3-ethoxycarbonyl-2-methylsulfanyl-indolizin-1-yl]-phenyl-methyl]-2-methylsulfanyl-indolizine-3-carboxylate CAS Name: 7-(dimethylamino)-1-[[7-(dimethylamino)-3-ethoxycarbonyl-2-(methylthio)-1-indolizinyl]-phenylmethyl]-2-(methylthio)-3-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-(dimethylamino)-1-[[7-(dimethylamino)-3-ethoxycarbonyl-2-methylsulfanylindolizin-1-yl]-phenylmethyl]-2-methylsulfanylindolizine-3-carboxylate Traditional Name: 1-[[3-carbethoxy-7-(dimethylamino)-2-(methylthio)indolizin-1-yl]-phenyl-methyl]-7-(dimethylamino)-2-(methylthio)indolizine-3-carboxylic acid ethyl ester Formula: C35H40N4O4S2 MolecularWeight: 644.8465

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2N1C=CC(=C2)N(C)C)C(C3=CC=CC=C3)C4=C5C=C(C=CN5C(=C4SC)C(=O)OCC)N(C)C)SC

Isomeric SMILES

CCOC(=O)C1=C(C(=C2N1C=CC(=C2)N(C)C)C(C3=CC=CC=C3)C4=C5C=C(C=CN5C(=C4SC)C(=O)OCC)N(C)C)SC

InChI

InChI=1S/C35H40N4O4S2/c1-9-42-34(40)30-32(44-7)28(25-20-23(36(3)4)16-18-38(25)30)27(22-14-12-11-13-15-22)29-26-21-24(37(5)6)17-19-39(26)31(33(29)45-8)35(41)43-10-2/h11-21,27H,9-10H2,1-8H3